Spectroscopic characterization and DFT-based structural analysis of a novel sulfonyl-acetamide imidazole derivative with multi-target protein docking studies. [PDF]
Geetha R +8 more
europepmc +1 more source
PRISM, a Bidirectional NMR Foundation Model: From Peak List to Structure and Back
Structure elucidation from NMR can consume an expert for hours or even days. PRISM addresses this with a bidirectional transformer trained on 1.19 M real experimental spectra: it translates 1H and 13C peak lists into structures with 60.1% stereo‐aware top‐1 accuracy (72.5% stereo‐unaware), and, working in reverse, predicts spectra back from structures,
Ajnabiul Hoque, Frank Glorius
wiley +1 more source
A Direct Arylation Approach for Helicene Analogues Composed of Unidirectional Amide Linkages. [PDF]
Yokoyama A +5 more
europepmc +1 more source
Nature programs distinct secondary structures and functions through subtle stereochemical differences, as exemplified by amylose and cellulose. Translating this principle into synthetic ladder polymers, stereochemical sequence control gives rise to diastereomeric coil‐ and ribbon‐type helices with complementary chiral recognition, demonstrating ...
Tomoyuki Ikai +4 more
wiley +1 more source
Preparation, characterization, and catalytic performance of a 2,3-dihydroxybenzoic acid-based deep eutectic solvent for the synthesis of chromenoquinolinones. [PDF]
Goudarzi H +3 more
europepmc +1 more source
NHC‐Copper(I)‐Mediated Functionalization of White Phosphorus
White phosphorus is functionalized by N‐heterocyclic carbene supported copper(I) complexes through redox‐neutral steps. Treatment of the resulting complexes with electrophiles releases the ligands from the metal center as asymmetrically substituted organophosphorus butterfly compounds.
Thomas M. Horsley Downie +4 more
wiley +1 more source
Extension of the Pnictinous Acid Series: Rational Synthesis of a Stibinous Acid and Exploration of Its Reactivity. [PDF]
Tra BYE, Getahun A, Johnstone TC.
europepmc +1 more source
Oxygen‐tolerant photoinduced electron/energy transfer reversible addition–fragmentation chain transfer (PET‐RAFT) polymerization enables the controlled radical ring‐opening (rROP) copolymerization of cyclic dithiothreitol (cDTT) with less‐activated vinyl monomers, affording degradable polymers with predictable molecular weights, low dispersities, and ...
Alessandro Magro +5 more
wiley +1 more source
A Thiosemicarbazone Schiff Base and Its Titanium(IV) Complexes: Spectral Analysis, DFT Studies, and Biological Evaluation. [PDF]
Ghanghas P +6 more
europepmc +1 more source

